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MedKoo Cat#: 463994 | Name: Penthienate Br

Description:

WARNING: This product is for research use only, not for human or veterinary use.

Penthienate Br is an antimuscarinic agent.

Chemical Structure

Penthienate Br
Penthienate Br
CAS#60-44-6

Theoretical Analysis

MedKoo Cat#: 463994

Name: Penthienate Br

CAS#: 60-44-6

Chemical Formula: C18H30BrNO3S

Exact Mass: 419.1130

Molecular Weight: 420.41

Elemental Analysis: C, 51.43; H, 7.19; Br, 19.01; N, 3.33; O, 11.42; S, 7.63

Price and Availability

This product is currently not in stock but may be available through custom synthesis. To ensure cost efficiency, the minimum order quantity is 1 gram. The estimated lead time is 2 to 4 months, with pricing dependent on the complexity of the synthesis (typically high for intricate chemistries). Quotes for quantities below 1 gram will not be provided. To request a quote, please click the button below. Note: If this product becomes available in stock in the future, pricing will be listed accordingly.
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Related CAS #
No Data
Synonym
Penthienate Br; Monodral bromide; NSC 61814; NSC61814; NSC-61814;
IUPAC/Chemical Name
2-(2-cyclopentyl-2-hydroxy-2-(thiophen-2-yl)acetoxy)-N,N-diethyl-N-methylethan-1-aminium bromide
InChi Key
VWGJUXTWIWCQGL-UHFFFAOYSA-M
InChi Code
InChI=1S/C18H30NO3S.BrH/c1-4-19(3,5-2)12-13-22-17(20)18(21,15-9-6-7-10-15)16-11-8-14-23-16;/h8,11,14-15,21H,4-7,9-10,12-13H2,1-3H3;1H/q+1;/p-1
SMILES Code
CC[N+](CC)(CCOC(C(C1CCCC1)(c2sccc2)O)=O)C.[Br-]
Appearance
Solid powder
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility
Soluble in DMSO
Shelf Life
>2 years if stored properly
Drug Formulation
This drug may be formulated in DMSO
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 420.41 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL
1: Coombes GM, Millard RJ. Urinary urge incontinence: randomised crossover trials of penthienate versus placebo and propantheline. Med J Aust. 1996 Nov 4;165(9):473-6. doi: 10.5694/j.1326-5377.1996.tb138610.x. PMID: 8937366. 2: Clarke B. Anticholinergic medication for the unstable bladder: prospective trials of imipramine/propantheline versus penthienate and oxybutynin versus penthienate. Int Urogynecol J Pelvic Floor Dysfunct. 1996;7(4):191-5. doi: 10.1007/BF01907071. PMID: 10895803.